6,7-dimethoxy-N-(2-methoxy-5-nitrophenyl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,7-dimethoxy-N-(2-methoxy-5-nitrophenyl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
6,7-dimethoxy-N-(2-methoxy-5-nitrophenyl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C168-0507 |
| Compound Name: | 6,7-dimethoxy-N-(2-methoxy-5-nitrophenyl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 455.47 |
| Molecular Formula: | C23 H25 N3 O7 |
| Smiles: | CC(C)CN1C=C(C(Nc2cc(ccc2OC)[N+]([O-])=O)=O)c2cc(c(cc2C1=O)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5047 |
| logD: | 2.1406 |
| logSw: | -3.8243 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.138 |
| InChI Key: | XVIHOQATXYAYOZ-UHFFFAOYSA-N |